============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. TYR 3 0.840 34.658-221.215 29.840 -99.200 -91.000 HIS 6 0.900 34.115-221.698 35.374 -99.200 -91.000 PHE 10 1.000 18.954-216.378 33.559 -99.200 -91.000 TYR 17 0.840 24.590-224.624 38.333 -99.200 -91.000 TYR 21 0.840 28.694-223.492 42.505 -99.200 -91.000 PHE 23 1.000 21.953-217.640 48.728 -99.200 -91.000 TYR 62 0.840 32.645-212.901 61.383 -99.200 -91.000 PHE 64 1.000 30.893-205.538 60.266 -99.200 -91.000 PHE 95 1.000 17.393-192.081 53.098 -99.200 -91.000 TYR 97 0.840 24.987-183.600 51.674 -99.200 -91.000 TYR 99 0.840 17.074-188.916 49.238 -99.200 -91.000 TYR 101 0.840 13.851-189.658 55.641 -99.200 -91.000 TYR 119 0.840 27.737-206.596 43.577 -99.200 -91.000 TYR 124 0.840 32.162-204.914 36.389 -99.200 -91.000 PHE 134 1.000 21.534-204.275 56.267 -99.200 -91.000 TYR 146 0.840 12.628-204.739 56.931 -99.200 -91.000 TYR 153 0.840 13.919-213.205 49.502 -99.200 -91.000 TYR 154 0.840 14.096-205.762 50.842 -99.200 -91.000 TYR 157 0.840 13.439-212.930 57.497 -99.200 -91.000 HIS 176 0.900 8.217-217.391 71.964 -99.200 -91.000 PHE 177 1.000 8.152-215.162 67.674 -99.200 -91.000 HIS 183 0.900 5.518-207.895 70.647 -99.200 -91.000 TRP 188 1.040 18.338-202.754 76.778 -99.200 -91.000 TRP6 188 1.020 20.349-203.922 77.194 -99.200 -91.000 PHE 194 1.000 12.380-215.448 73.238 -99.200 -91.000 HIS 198 0.900 13.180-219.532 72.898 -99.200 -91.000 PHE 207 1.000 25.815-220.206 73.108 -99.200 -91.000 PHE 222 1.000 23.521-202.291 66.556 -99.200 -91.000 PHE 223 1.000 22.659-200.711 73.478 -99.200 -91.000